SCHEMBL7266278

SCHEMBL7266278

CCS(=O)(=O)C[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CCOC(C)=O)C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 1/20 0.48
▸ TACR1 P25103 1/20 0.48
▸ CASP3 P42574 1/20 0.42
▸ REN P00797 2/20 0.42
▸ MME P08473 5/20 0.41
▸ ACE P12821 1/20 0.41
▸ CPA1 P15085 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ PSMB5 P28074 2/20 0.41
▸ ECE1 P42892 3/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ ANPEP P15144 1/20 0.40
▸ OPRM1 P35372 1/20 0.39
▸ OPRD1 P41143 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ PTPN1 P18031 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ CTSK P43235 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7274203 0.91 HRH4 (0.51) HRH4TACR1RENMMEACE
SCHEMBL7278303 0.82 MME (0.42) HRH4TACR1CASP3RENMME
SCHEMBL7278306 0.82 MME (0.42) HRH4TACR1CASP3RENMME
SCHEMBL7278116 0.81 MME (0.48) HRH4RENMMEACECPA1
SCHEMBL7266389 0.80 HRH4 (0.57) HRH4MMEACECPA1ACE2
SCHEMBL7273018 0.79 HRH4 (0.44) HRH4TACR1MMEACECPA1
SCHEMBL9064422 0.79 HRH4 (0.44) HRH4TACR1MMEACECPA1
SCHEMBL7267914 0.78 HRH4 (0.53) HRH4RENMMEACECPA1
SCHEMBL7278135 0.78 HRH4 (0.53) HRH4RENMMEACECPA1
SCHEMBL7267936 0.78 MME (0.59) MMEECE1HDAC1HDAC2ANPEP

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0309766-B1 N-acylamino acid derivatives and their use BANYU PHARMA CO LTD (JP) 1998-04-15 — — EP disclosed
US-5506356-A RENIN INHIBITORS; HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-04-09 — — US disclosed
US-5481036-A RENIN INHIBITORS, HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-01-02 — — US disclosed
US-5319082-A N-acylamino acid derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-06-07 — — US disclosed
US-5240924-A Dipeptide hypotensives BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-08-31 — — US disclosed
US-5122523-A Hypotensive agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1992-06-16 — — US disclosed
EP-0309766-A2 N-acylamino acid derivatives and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 — — EP disclosed
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